methyl 2-[(6-azanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]ethanoate

Systemtic Name: methyl 2-[(6-azanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]ethanoate Openeye Name: methyl 2-[(6-amino-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]acetate CAS Name: 2-[(6-amino-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]acetic acid methyl ester IUPAC Name: methyl 2-[(6-amino-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]acetate Traditional Name: 2-[(6-amino-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]acetic acid methyl ester Formula: C12H15NO4S MolecularWeight: 269.3168

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSCC1=CC2=C(C=C1N)OCCO2

Isomeric SMILES

COC(=O)CSCC1=CC2=C(C=C1N)OCCO2

InChI

InChI=1S/C12H15NO4S/c1-15-12(14)7-18-6-8-4-10-11(5-9(8)13)17-3-2-16-10/h4-5H,2-3,6-7,13H2,1H3